7. Applications
The applications of polymer molecular simulation presented in this section are intended to give an overview of what is possible in this field, and to show its limitations. For a more detailed analysis of each case, please refer to the bibliography.
7.1 Case study in the design of a new polymer
The article by Eichinger et al. raises the main difficulties involved in the design of new polymers with specific properties, and attempts to solve them
The Ultimate Scientific and Technical Reference
This article is included in
Physics and chemistry
This offer includes:
Knowledge Base
Updated and enriched with articles validated by our scientific committees
Services
A set of exclusive tools to complement the resources
Practical Path
Operational and didactic, to guarantee the acquisition of transversal skills
Doc & Quiz
Interactive articles with quizzes, for constructive reading
Applications
Conclusion
Bibliography
- (1) - - https://www.nobelprize.org/nobel_prizes/chemistry/laureates/2013/ .
- (2) - JENSEN (F.) - Introduction to Computational Chemistry Computational...
Software tools
Multi-scale :
Commercial code: Materials Studio by Biovia, Dassault Systemes : https://www.3ds.com/products-services/biovia/products/molecular-modeling-simulation/biovia-materials-studio/
Free code: OCTA...
The Ultimate Scientific and Technical Reference
